2-[4-(2-acetyloxyethyl)-1,4-dimethyl-piperazine-1,4-diium-1-yl]ethyl ethanoate dichloride

Systemtic Name: 2-[4-(2-acetyloxyethyl)-1,4-dimethyl-piperazine-1,4-diium-1-yl]ethyl ethanoate dichloride Openeye Name: 2-[4-(2-acetoxyethyl)-1,4-dimethyl-piperazine-1,4-diium-1-yl]ethyl acetate dichloride CAS Name: acetic acid 2-[4-(2-acetyloxyethyl)-1,4-dimethyl-1-piperazine-1,4-diiumyl]ethyl ester dichloride IUPAC Name: 2-[4-(2-acetyloxyethyl)-1,4-dimethylpiperazine-1,4-diium-1-yl]ethyl acetate dichloride Traditional Name: acetic acid 2-[4-(2-acetoxyethyl)-1,4-dimethyl-piperazine-1,4-diium-1-yl]ethyl ester dichloride Formula: C28H56Cl2N4O8+2 MolecularWeight: 647.67224

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[N+]1(CC[N+](CC1)(C)CCOC(=O)C)C.CC(=O)OCC[N+]1(CC[N+](CC1)(C)CCOC(=O)C)C.[Cl-].[Cl-]

Isomeric SMILES

CC(=O)OCC[N+]1(CC[N+](CC1)(C)CCOC(=O)C)C.CC(=O)OCC[N+]1(CC[N+](CC1)(C)CCOC(=O)C)C.[Cl-].[Cl-]

InChI

InChI=1S/2C14H28N2O4.2ClH/c2*1-13(17)19-11-9-15(3)5-7-16(4,8-6-15)10-12-20-14(2)18;;/h2*5-12H2,1-4H3;2*1H/q2*+2;;/p-2